Geometry & MOs

Info

ID:

223829

PubChem CID:

85335632

Reduced:

NSSiO3C35H47 (1)

Stoich.:

ABCD3E35F47 (1)

Weight, g/mol:

590.244875

ΔHf, kcal/mol:

-151.83

Dipole, Da:

3.82

IP(EA), eV:

 -9.01(-0.28)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[[4-amino-2-[[2-[[2-[2-[[2-amino-3-(1H-indol-3-yl)propanoyl]amino]propanoylamino]-3-hydroxypropanoyl]amino]acetyl]amino]-4-oxobutanoyl]amino]acetic acid

Drug info:

PubChemData

Smile

CC1=NC(=CS1)C=C(C)C(C(C)C=C(C)CCCC(C)C=O)O[Si](C2=CC=CC=C2)(C3=CC=CC=C3)OC(C)(C)C

DOS

IR

Vibrations